[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate

Systemtic Name: [2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Openeye Name: [2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl] 2-(1-naphthyl)quinoline-4-carboxylate CAS Name: 2-(1-naphthalenyl)-4-quinolinecarboxylic acid [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 2-naphthalen-1-ylquinoline-4-carboxylate Traditional Name: 2-(1-naphthyl)cinchoninic acid [2-[(2-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C29H21ClN2O3 MolecularWeight: 480.94164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)OCC(=O)NCC5=CC=CC=C5Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC4=CC=CC=C4C(=C3)C(=O)OCC(=O)NCC5=CC=CC=C5Cl

InChI

InChI=1S/C29H21ClN2O3/c30-25-14-5-2-9-20(25)17-31-28(33)18-35-29(34)24-16-27(32-26-15-6-4-12-23(24)26)22-13-7-10-19-8-1-3-11-21(19)22/h1-16H,17-18H2,(H,31,33)